chempirical

Naftifine

C21H21NCAS 65472-88-0287.41 g/mol

Open in Covalent MOL file
N
AlkeneTertiary amine

Properties

Molecular formula
C21H21N
Molar mass
287.41 g/mol
Exact mass
287.1674 Da
Boiling point
162–167 °C (at 0.015 Torr)
logP
4.99Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
5
Double bonds
EE/Z, in SMILES order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
65472-88-0
SMILES
CN(C/C=C/c1ccccc1)Cc1cccc2ccccc12
InChIKey
OZGNYLLQHRPOBR-DHZHZOJOSA-N
InChI
InChI=1S/C21H21N/c1-22(16-8-11-18-9-3-2-4-10-18)17-20-14-7-13-19-12-5-6-15-21(19)20/h2-15H,16-17H2,1H3/b11-8+

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 1-Naphthalenemethanamine, N-methyl-N-[(2E)-3-phenyl-2-propen-1-yl]-
  • 1-Naphthalenemethanamine, N-methyl-N-(3-phenyl-2-propenyl)-, (E)-
  • 1-Naphthalenemethanamine, N-methyl-N-[(2E)-3-phenyl-2-propenyl]-
  • N-Methyl-N-[(2E)-3-phenyl-2-propen-1-yl]-1-naphthalenemethanamine
  • Naftifungin
  • Nafetifine

Work with Naftifine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Naftifine hydrochloride65473-14-5Salt

Similar compounds

Terbinafine91161-71-658 % similar Terbinafine hydrochloride78628-80-555 % similar Butenafine101828-21-151 % similar Butenafine hydrochloride101827-46-748 % similar 1-Ethylnaphthalene1127-76-040 % similar 1-(Bromomethyl)naphthalene3163-27-740 % similar 1-(1-Naphthylmethyl)piperazine40675-81-840 % similar 1,2-Di(alpha-naphthyl)ethane15374-45-539 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Tri-p-tolylamine1159-53-1 Cyproheptadine129-03-3 Tribenzylamine620-40-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook